rel-(2R,7aS)-2-(3-methoxyphenyl)-5-oxo-N-[2-(thiophen-2-yl)ethyl]hexahydro-1H-pyrrolizine-2-carboxamide
Chemical Structure Depiction of
rel-(2R,7aS)-2-(3-methoxyphenyl)-5-oxo-N-[2-(thiophen-2-yl)ethyl]hexahydro-1H-pyrrolizine-2-carboxamide
rel-(2R,7aS)-2-(3-methoxyphenyl)-5-oxo-N-[2-(thiophen-2-yl)ethyl]hexahydro-1H-pyrrolizine-2-carboxamide
Compound characteristics
| Compound ID: | SC91-0416 |
| Compound Name: | rel-(2R,7aS)-2-(3-methoxyphenyl)-5-oxo-N-[2-(thiophen-2-yl)ethyl]hexahydro-1H-pyrrolizine-2-carboxamide |
| Molecular Weight: | 384.5 |
| Molecular Formula: | C21 H24 N2 O3 S |
| Smiles: | COc1cccc(c1)[C@@]1(C[C@@H]2CCC(N2C1)=O)C(NCCc1cccs1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.161 |
| logD: | 2.161 |
| logSw: | -2.8156 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.33 |
| InChI Key: | VVCWUYSUDNUXKM-HRAATJIYSA-N |